Information card for entry 7203484

Structure parameters

• Formula: C28 H40 F9 La N3 O20.5 S3
• Calculated formula: C28 H24 F9 La N3 O20.5 S3
• Title of publication: 2-D coordination network of a cyclic amide with a lanthanide metal cation and its columnar stacking
• Authors of publication: Masu, Hyuma; Tominaga, Masahide; Katagiri, Kosuke; Kato, Takako; Azumaya, Isao
• Journal of publication: CrystEngComm
• Year of publication: 2006
• Journal volume: 8
• Journal issue: 8
• Pages of publication: 578
• a: 21.3144 ± 0.0005 Å
• b: 21.3144 ± 0.0005 Å
• c: 17.3882 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 6841.2 ± 0.4 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 7
• Space group number: 174
• Hermann-Mauguin space group symbol: P -6
• Hall space group symbol: P -6
• Residual factor for all reflections: 0.0771
• Residual factor for significantly intense reflections: 0.0439
• Weighted residual factors for significantly intense reflections: 0.096
• Weighted residual factors for all reflections included in the refinement: 0.1121
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No